pent-1-ene;pentylidenecyclopropane

C13H24 — CID 173050436

IUPACpent-1-ene;pentylidenecyclopropane
SMILESC=CCCC.CCCCC=C1CC1
InChIInChI=1S/C8H14.C5H10/c1-2-3-4-5-8-6-7-8;1-3-5-4-2/h5H,2-4,6-7H2,1H3;3H,1,4-5H2,2H3
InChIKeyVIABDURRCSPERD-UHFFFAOYSA-N
MW180.33 g/mol
LogP4.87
Rot. Bonds5

About pent-1-ene;pentylidenecyclopropane

pent-1-ene;pentylidenecyclopropane (PubChem CID 173050436) has the molecular formula C13H24 and a molecular weight of 180.33 g/mol. Its IUPAC name is pent-1-ene;pentylidenecyclopropane.

Molecular Properties

Compound Namepent-1-ene;pentylidenecyclopropane
PubChem CID173050436
Molecular FormulaC13H24
Molecular Weight180.33 g/mol
Exact Mass180.19
IUPAC Namepent-1-ene;pentylidenecyclopropane
SMILESC=CCCC.CCCCC=C1CC1
InChIInChI=1S/C8H14.C5H10/c1-2-3-4-5-8-6-7-8;1-3-5-4-2/h5H,2-4,6-7H2,1H3;3H,1,4-5H2,2H3
InChIKeyVIABDURRCSPERD-UHFFFAOYSA-N
XLogP4.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.33
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

heptadecylidenecyclopropane
CID 19760704
1,4-di(butylidene)cyclohexane
CID 175542706
pentylidenecyclopentadecane
CID 151655236
decane;pent-1-ene
CID 159058331
hexylidenecyclobutane
CID 86127710
ethane;pent-1-ene;propane
CID 162735255
(111C)pent-1-ene
CID 177423582
hex-1-ene;oct-1-ene;pent-1-ene
CID 174703469
dodecylidenecyclobutane
CID 176570971
decylidenecyclobutane
CID 15365573
4-pentylidenecyclohexan-1-amine
CID 79880726
hex-1-ene;zinc
CID 174554611

Frequently Asked Questions

What is the IUPAC name of pent-1-ene;pentylidenecyclopropane?
The IUPAC name of pent-1-ene;pentylidenecyclopropane (CID 173050436) is pent-1-ene;pentylidenecyclopropane.
What is the SMILES notation for pent-1-ene;pentylidenecyclopropane?
The canonical SMILES for pent-1-ene;pentylidenecyclopropane is C=CCCC.CCCCC=C1CC1.
What is the InChIKey of pent-1-ene;pentylidenecyclopropane?
The InChIKey is VIABDURRCSPERD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14.C5H10/c1-2-3-4-5-8-6-7-8;1-3-5-4-2/h5H,2-4,6-7H2,1H3;3H,1,4-5H2,2H3.
What are the key properties of pent-1-ene;pentylidenecyclopropane?
pent-1-ene;pentylidenecyclopropane has a molecular weight of 180.33 g/mol, XLogP of 4.87, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for pent-1-ene;pentylidenecyclopropane is sourced from PubChem (CID 173050436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).